盐酸米诺环素结构式

中文名称:盐酸米诺环素
英文名称:Minocycline hydrochloride
CAS No.:13614-98-7
分子式:C23H28ClN3O7 分子量:493.9373
盐酸米诺环素 数据
Mol:
0 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.7983    1.5700    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.7983    0.0000    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.1580    2.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790    1.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0790    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7193    2.3550    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    1.5700    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0000    2.3550    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    0.0000    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.7193    3.9250    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3597    4.7100    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  2  3  1  0  0  0  0
  3  4  1  0  0  0  0
  3  5  1  0  0  0  0
  5  6  2  0  0  0  0
  6  7  1  0  0  0  0
  7  8  2  0  0  0  0
  8  9  1  0  0  0  0
  8 10  1  0  0  0  0
 10 11  2  0  0  0  0
 11  5  1  0  0  0  0
  7 12  1  0  0  0  0
 12 13  2  0  0  0  0
 12 14  1  0  0  0  0
 14 15  2  0  0  0  0
 15 16  1  0  0  0  0
 15 17  1  0  0  0  0
 17 18  1  0  0  0  0
 17 19  1  0  0  0  0
 19 20  1  0  0  0  0
 20 21  1  0  0  0  0
 21 14  1  0  0  0  0
 21 22  1  0  0  0  0
 22  6  1  0  0  0  0
 19 23  1  0  0  0  0
 23 24  1  0  0  0  0
 24 25  1  0  0  0  0
 24 26  1  0  0  0  0
 23 27  1  0  0  0  0
 27 28  1  0  0  0  0
 27 29  2  0  0  0  0
 29 30  1  0  0  0  0
 30 31  1  0  0  0  0
 30 32  2  0  0  0  0
 29 33  1  0  0  0  0
 33 17  1  0  0  0  0
 33 34  2  0  0  0  0
M  END                                
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盐酸米诺环素 Smile 编码:
Cl.CN(C1C=CC(O)=C2C(C3C(CC=12)CC1C(C(=C(C(=O)C1(O)C=3O)C(=O)N)O)N(C)C)=O)C
盐酸米诺环素 InChi 编码:
1S/C23H27N3O7.ClH/c1-25(2)12-5-6-13(27)15-10(12)7-9-8-11-17(26(3)4)19(29)16(22(24)32)21(31)23(11,33)20(30)14(9)18(15)28;/h5-6,9,11,17,27-28,31,33H,7-8H2,1-4H3,(H2,24,32);1H/t9-,11-,17-,23-;/m0./s1
盐酸米诺环素 InChiKey 编码:
WTJXVDPDEQKTCV-VQAITOIOSA-N